COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -2.440   3.098  -0.291  1.00  0.00           C  
HETATM    2  C   UNL     1      -1.395   2.036  -0.065  1.00  0.00           C  
HETATM    3  C   UNL     1      -1.620   0.792   0.404  1.00  0.00           C  
HETATM    4  C   UNL     1      -0.377   0.131   0.461  1.00  0.00           C  
HETATM    5  C   UNL     1       0.561   0.996   0.023  1.00  0.00           C  
HETATM    6  N   UNL     1      -0.058   2.165  -0.306  1.00  0.00           N  
HETATM    7  C   UNL     1      -2.956   0.216   0.798  1.00  0.00           C  
HETATM    8  C   UNL     1      -3.590  -0.444  -0.400  1.00  0.00           C  
HETATM    9  O   UNL     1      -3.017  -0.446  -1.463  1.00  0.00           O  
HETATM   10  O   UNL     1      -4.793  -1.029  -0.285  1.00  0.00           O  
HETATM   11  C   UNL     1      -0.140  -1.283   0.925  1.00  0.00           C  
HETATM   12  C   UNL     1      -0.251  -2.236  -0.267  1.00  0.00           C  
HETATM   13  C   UNL     1      -0.014  -3.650   0.197  1.00  0.00           C  
HETATM   14  O   UNL     1       0.220  -3.873   1.362  1.00  0.00           O  
HETATM   15  O   UNL     1      -0.062  -4.663  -0.683  1.00  0.00           O  
HETATM   16  N   UNL     1      -2.769   3.741   0.988  1.00  0.00           N  
HETATM   17  I   UNL     1       2.614   0.607  -0.130  1.00  0.00           I  
HETATM   18  H   UNL     1      -2.054   3.845  -0.985  1.00  0.00           H  
HETATM   19  H   UNL     1      -3.337   2.642  -0.710  1.00  0.00           H  
HETATM   20  H   UNL     1       0.380   2.959  -0.650  1.00  0.00           H  
HETATM   21  H   UNL     1      -2.815  -0.522   1.587  1.00  0.00           H  
HETATM   22  H   UNL     1      -3.604   1.015   1.158  1.00  0.00           H  
HETATM   23  H   UNL     1      -5.159  -1.439  -1.080  1.00  0.00           H  
HETATM   24  H   UNL     1       0.856  -1.360   1.360  1.00  0.00           H  
HETATM   25  H   UNL     1      -0.886  -1.550   1.674  1.00  0.00           H  
HETATM   26  H   UNL     1      -1.247  -2.159  -0.702  1.00  0.00           H  
HETATM   27  H   UNL     1       0.495  -1.970  -1.016  1.00  0.00           H  
HETATM   28  H   UNL     1       0.097  -5.552  -0.338  1.00  0.00           H  
HETATM   29  H   UNL     1      -1.942   4.116   1.428  1.00  0.00           H  
HETATM   30  H   UNL     1      -3.468   4.457   0.863  1.00  0.00           H  
CONECT    1   16    2   18   19                                       
CONECT    2    6    1    3    3                                       
CONECT    3    2    2    4    7                                       
CONECT    4    5    5    3   11                                       
CONECT    5   17    6    4    4                                       
CONECT    6    5    2   20                                            
CONECT    7    3    8   21   22                                       
CONECT    8    9    9    7   10                                       
CONECT    9    8    8                                                 
CONECT   10    8   23                                                 
CONECT   11    4   12   24   25                                       
CONECT   12   11   13   26   27                                       
CONECT   13   12   14   14   15                                       
CONECT   14   13   13                                                 
CONECT   15   13   28                                                 
CONECT   16    1   29   30                                            
CONECT   17    5                                                      
CONECT   18    1                                                      
CONECT   19    1                                                      
CONECT   20    6                                                      
CONECT   21    7                                                      
CONECT   22    7                                                      
CONECT   23   10                                                      
CONECT   24   11                                                      
CONECT   25   11                                                      
CONECT   26   12                                                      
CONECT   27   12                                                      
CONECT   28   15                                                      
CONECT   29   16                                                      
CONECT   30   16                                                      
MASTER        0    0    0    0    0    0    0    0   30    0   30    0
END
